Re: AMBER: Can we load prmtop and inpcrd files into xleap?

From: Bill Ross <>
Date: Wed, 18 May 2005 21:49:04 -0700 (PDT)

You would have to extrapolate the equivalent of a frcmod file
from the prmtop, and have it overlay ONLY the unit and not
others when doing a saveamberparm. Then there might have to
be a special edit cmd or argument type to get that frcmod.

Which is not appealing enough a task for anyone yet.

The AMBER Mail Reflector
To post, send mail to
To unsubscribe, send "unsubscribe amber" to
Received on Thu May 19 2005 - 05:53:00 PDT
Custom Search